3-(2-oxidanylidene-3-phenyl-1,3-diazinan-1-yl)propanoic acid

Systemtic Name: 3-(2-oxidanylidene-3-phenyl-1,3-diazinan-1-yl)propanoic acid Openeye Name: 3-(2-oxo-3-phenyl-hexahydropyrimidin-1-yl)propanoic acid CAS Name: 3-(2-oxo-3-phenyl-1,3-diazinan-1-yl)propanoic acid IUPAC Name: 3-(2-oxo-3-phenyl-1,3-diazinan-1-yl)propanoic acid Traditional Name: 3-(2-keto-3-phenyl-hexahydropyrimidin-1-yl)propionic acid Formula: C13H16N2O3 MolecularWeight: 248.27774

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)N(C1)C2=CC=CC=C2)CCC(=O)O

Isomeric SMILES

C1CN(C(=O)N(C1)C2=CC=CC=C2)CCC(=O)O

InChI

InChI=1S/C13H16N2O3/c16-12(17)7-10-14-8-4-9-15(13(14)18)11-5-2-1-3-6-11/h1-3,5-6H,4,7-10H2,(H,16,17)